1-spiro[4H-1,3-benzodioxine-2,4'-piperidine]-6-ylisoquinolin-3-amine

Systemtic Name: 1-spiro[4H-1,3-benzodioxine-2,4'-piperidine]-6-ylisoquinolin-3-amine Openeye Name: 1-spiro[4H-1,3-benzodioxine-2,4'-piperidine]-6-ylisoquinolin-3-amine CAS Name: 1-(6-spiro[4H-1,3-benzodioxin-2,4'-piperidine]yl)-3-isoquinolinamine IUPAC Name: 1-spiro[4H-1,3-benzodioxine-2,4'-piperidine]-6-ylisoquinolin-3-amine Traditional Name: (1-spiro[4H-1,3-benzodioxin-2,4'-piperidine]-6-yl-3-isoquinolyl)amine Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC12OCC3=C(O2)C=CC(=C3)C4=NC(=CC5=CC=CC=C54)N

Isomeric SMILES

C1CNCCC12OCC3=C(O2)C=CC(=C3)C4=NC(=CC5=CC=CC=C54)N

InChI

InChI=1S/C21H21N3O2/c22-19-12-14-3-1-2-4-17(14)20(24-19)15-5-6-18-16(11-15)13-25-21(26-18)7-9-23-10-8-21/h1-6,11-12,23H,7-10,13H2,(H2,22,24)